[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-oxidanylidene-propyl]-diethyl-azanium chloride

Systemtic Name: [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-oxidanylidene-propyl]-diethyl-azanium chloride Openeye Name: [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-oxo-propyl]-diethyl-ammonium chloride CAS Name: [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-oxopropyl]-diethylammonium chloride IUPAC Name: [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-oxopropyl]-diethylazanium chloride Traditional Name: [3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-keto-propyl]-diethyl-ammonium chloride Formula: C16H24ClNO3 MolecularWeight: 313.81966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC(=O)C1=CC2=C(C=C1)OCCCO2.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCC(=O)C1=CC2=C(C=C1)OCCCO2.[Cl-]

InChI

InChI=1S/C16H23NO3.ClH/c1-3-17(4-2)9-8-14(18)13-6-7-15-16(12-13)20-11-5-10-19-15;/h6-7,12H,3-5,8-11H2,1-2H3;1H